1-[4-(diphenylmethyl)piperazin-1-yl]-3-propyl-indole-2-carboxylic acid

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-3-propyl-indole-2-carboxylic acid Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-propyl-indole-2-carboxylic acid CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-3-propyl-2-indolecarboxylic acid IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-propylindole-2-carboxylic acid Traditional Name: 1-(4-benzhydrylpiperazino)-3-propyl-indole-2-carboxylic acid Formula: C29H31N3O2 MolecularWeight: 453.57534

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N(C2=CC=CC=C21)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

CCCC1=C(N(C2=CC=CC=C21)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C29H31N3O2/c1-2-11-25-24-16-9-10-17-26(24)32(28(25)29(33)34)31-20-18-30(19-21-31)27(22-12-5-3-6-13-22)23-14-7-4-8-15-23/h3-10,12-17,27H,2,11,18-21H2,1H3,(H,33,34)